N,N-dimethyl-4-oxochromene-6-carboxamide

C12H11NO3 — CID 175524787

IUPACN,N-dimethyl-4-oxochromene-6-carboxamide
SMILESCN(C)C(=O)c1ccc2occc(=O)c2c1
InChIInChI=1S/C12H11NO3/c1-13(2)12(15)8-3-4-11-9(7-8)10(14)5-6-16-11/h3-7H,1-2H3
InChIKeyTZXNQXFWYQJXER-UHFFFAOYSA-N
MW217.22 g/mol
LogP1.49
Rot. Bonds1

About N,N-dimethyl-4-oxochromene-6-carboxamide

N,N-dimethyl-4-oxochromene-6-carboxamide (PubChem CID 175524787) has the molecular formula C12H11NO3 and a molecular weight of 217.22 g/mol. Its IUPAC name is N,N-dimethyl-4-oxochromene-6-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-oxochromene-6-carboxamide
PubChem CID175524787
Molecular FormulaC12H11NO3
Molecular Weight217.22 g/mol
Exact Mass217.07
IUPAC NameN,N-dimethyl-4-oxochromene-6-carboxamide
SMILESCN(C)C(=O)c1ccc2occc(=O)c2c1
InChIInChI=1S/C12H11NO3/c1-13(2)12(15)8-3-4-11-9(7-8)10(14)5-6-16-11/h3-7H,1-2H3
InChIKeyTZXNQXFWYQJXER-UHFFFAOYSA-N
XLogP1.49
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.22
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-oxochromene-6-carboxamide?
The IUPAC name of N,N-dimethyl-4-oxochromene-6-carboxamide (CID 175524787) is N,N-dimethyl-4-oxochromene-6-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-oxochromene-6-carboxamide?
The canonical SMILES for N,N-dimethyl-4-oxochromene-6-carboxamide is CN(C)C(=O)c1ccc2occc(=O)c2c1.
What is the InChIKey of N,N-dimethyl-4-oxochromene-6-carboxamide?
The InChIKey is TZXNQXFWYQJXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO3/c1-13(2)12(15)8-3-4-11-9(7-8)10(14)5-6-16-11/h3-7H,1-2H3.
What are the key properties of N,N-dimethyl-4-oxochromene-6-carboxamide?
N,N-dimethyl-4-oxochromene-6-carboxamide has a molecular weight of 217.22 g/mol, XLogP of 1.49, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-oxochromene-6-carboxamide is sourced from PubChem (CID 175524787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).